N-[1-(3-azanyl-3-oxidanylidene-propyl)-5-[phenylcarbonyl(propyl)amino]benzimidazol-2-yl]-4-cyano-benzamide

Systemtic Name: N-[1-(3-azanyl-3-oxidanylidene-propyl)-5-[phenylcarbonyl(propyl)amino]benzimidazol-2-yl]-4-cyano-benzamide Openeye Name: N-[1-(3-amino-3-oxo-propyl)-5-[benzoyl(propyl)amino]benzimidazol-2-yl]-4-cyano-benzamide CAS Name: N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(propyl)amino]-2-benzimidazolyl]-4-cyanobenzamide IUPAC Name: N-[1-(3-amino-3-oxopropyl)-5-[benzoyl(propyl)amino]benzimidazol-2-yl]-4-cyanobenzamide Traditional Name: N-[1-(3-amino-3-keto-propyl)-5-[benzoyl(propyl)amino]benzimidazol-2-yl]-4-cyano-benzamide Formula: C28H26N6O3 MolecularWeight: 494.54444

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC2=C(C=C1)N(C(=N2)NC(=O)C3=CC=C(C=C3)C#N)CCC(=O)N)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCCN(C1=CC2=C(C=C1)N(C(=N2)NC(=O)C3=CC=C(C=C3)C#N)CCC(=O)N)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H26N6O3/c1-2-15-33(27(37)21-6-4-3-5-7-21)22-12-13-24-23(17-22)31-28(34(24)16-14-25(30)35)32-26(36)20-10-8-19(18-29)9-11-20/h3-13,17H,2,14-16H2,1H3,(H2,30,35)(H,31,32,36)